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ethyl 5-acetyl-2-({(Z)-2-cyano-2-[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]ethenyl}amino)-4-methyl-3-thiophenecarboxylate
SpectraBase Compound ID LMu6wag0pNi
InChI InChI=1S/C22H17Cl2N3O3S2/c1-4-30-22(29)18-11(2)19(12(3)28)32-21(18)26-9-13(8-25)20-27-17(10-31-20)15-6-5-14(23)7-16(15)24/h5-7,9-10,26H,4H2,1-3H3/b13-9-
InChIKey PGMPPCJHJNXEBI-LCYFTJDESA-N
Mol Weight 506.42 g/mol
Molecular Formula C22H17Cl2N3O3S2
Exact Mass 505.008839 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HgY2ZVwNfVY
Name ethyl 5-acetyl-2-({(Z)-2-cyano-2-[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]ethenyl}amino)-4-methyl-3-thiophenecarboxylate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C22H17Cl2N3O3S2/c1-4-30-22(29)18-11(2)19(12(3)28)32-21(18)26-9-13(8-25)20-27-17(10-31-20)15-6-5-14(23)7-16(15)24/h5-7,9-10,26H,4H2,1-3H3/b13-9-
InChIKey PGMPPCJHJNXEBI-LCYFTJDESA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_23685
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D43443; Labnumber: ULGA9-0010; SBI_ID: SBI-023689
Synonyms ethyl 5-acetyl-2-({2-cyano-2-[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]ethenyl}amino)-4-methyl-3-thiophenecarboxylate
Temperature 318 °C